Magnesium in PDB 9exq: Wzc-K540M-3YE-N711Y Mgadp C1
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Wzc-K540M-3YE-N711Y Mgadp C1
(pdb code 9exq). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 8 binding sites of Magnesium where determined in the
Wzc-K540M-3YE-N711Y Mgadp C1, PDB code: 9exq:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Magnesium binding site 1 out
of 8 in 9exq
Go back to
Magnesium Binding Sites List in 9exq
Magnesium binding site 1 out
of 8 in the Wzc-K540M-3YE-N711Y Mgadp C1
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Wzc-K540M-3YE-N711Y Mgadp C1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg1001
b:28.5
occ:1.00
|
O3B
|
D:ADP1000
|
1.9
|
22.6
|
1.0
|
OG1
|
D:THR541
|
2.2
|
8.9
|
1.0
|
PB
|
D:ADP1000
|
3.3
|
22.6
|
1.0
|
CB
|
D:THR541
|
3.6
|
8.9
|
1.0
|
OD2
|
D:ASP642
|
3.6
|
200.6
|
1.0
|
O1B
|
D:ADP1000
|
3.7
|
22.6
|
1.0
|
OD2
|
D:ASP564
|
3.9
|
13.6
|
1.0
|
N
|
D:THR541
|
4.0
|
8.9
|
1.0
|
O2B
|
D:ADP1000
|
4.2
|
22.6
|
1.0
|
O3A
|
D:ADP1000
|
4.3
|
22.6
|
1.0
|
OD1
|
D:ASP642
|
4.3
|
200.6
|
1.0
|
CA
|
D:THR541
|
4.3
|
8.9
|
1.0
|
CG
|
D:ASP642
|
4.4
|
200.6
|
1.0
|
CG2
|
D:THR541
|
4.5
|
8.9
|
1.0
|
OH
|
C:TYR713
|
4.5
|
16.6
|
1.0
|
O2A
|
D:ADP1000
|
4.6
|
22.6
|
1.0
|
O
|
D:THR643
|
4.7
|
91.8
|
1.0
|
CB
|
D:MET540
|
4.7
|
7.6
|
1.0
|
PA
|
D:ADP1000
|
4.9
|
22.6
|
1.0
|
CG
|
D:ASP564
|
4.9
|
13.6
|
1.0
|
C
|
D:MET540
|
4.9
|
7.6
|
1.0
|
O1A
|
D:ADP1000
|
4.9
|
22.6
|
1.0
|
|
Magnesium binding site 2 out
of 8 in 9exq
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Magnesium Binding Sites List in 9exq
Magnesium binding site 2 out
of 8 in the Wzc-K540M-3YE-N711Y Mgadp C1
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Wzc-K540M-3YE-N711Y Mgadp C1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Mg1001
b:23.9
occ:1.00
|
O3B
|
E:ADP1000
|
1.9
|
31.5
|
1.0
|
OG1
|
E:THR541
|
2.2
|
9.2
|
1.0
|
PB
|
E:ADP1000
|
3.2
|
31.5
|
1.0
|
O1B
|
E:ADP1000
|
3.5
|
31.5
|
1.0
|
CB
|
E:THR541
|
3.6
|
9.2
|
1.0
|
OD2
|
E:ASP564
|
3.8
|
11.3
|
1.0
|
OD2
|
E:ASP642
|
3.9
|
10.8
|
1.0
|
O3A
|
E:ADP1000
|
4.1
|
31.5
|
1.0
|
N
|
E:THR541
|
4.1
|
9.2
|
1.0
|
O2B
|
E:ADP1000
|
4.3
|
31.5
|
1.0
|
CA
|
E:THR541
|
4.4
|
9.2
|
1.0
|
CG2
|
E:THR541
|
4.5
|
9.2
|
1.0
|
O2A
|
E:ADP1000
|
4.5
|
31.5
|
1.0
|
OH
|
D:TYR713
|
4.5
|
16.1
|
1.0
|
OD1
|
E:ASP642
|
4.6
|
10.8
|
1.0
|
CG
|
E:ASP642
|
4.6
|
10.8
|
1.0
|
PA
|
E:ADP1000
|
4.7
|
31.5
|
1.0
|
O1A
|
E:ADP1000
|
4.7
|
31.5
|
1.0
|
CG
|
E:ASP564
|
4.8
|
11.3
|
1.0
|
O
|
E:THR643
|
4.9
|
9.2
|
1.0
|
CE
|
E:MET540
|
4.9
|
8.4
|
1.0
|
CE2
|
E:TYR569
|
5.0
|
31.7
|
1.0
|
|
Magnesium binding site 3 out
of 8 in 9exq
Go back to
Magnesium Binding Sites List in 9exq
Magnesium binding site 3 out
of 8 in the Wzc-K540M-3YE-N711Y Mgadp C1
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Wzc-K540M-3YE-N711Y Mgadp C1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Mg1001
b:21.8
occ:1.00
|
O3B
|
F:ADP1000
|
1.9
|
31.5
|
1.0
|
OG1
|
F:THR541
|
2.1
|
13.7
|
1.0
|
PB
|
F:ADP1000
|
3.3
|
31.5
|
1.0
|
CB
|
F:THR541
|
3.5
|
13.7
|
1.0
|
OD2
|
F:ASP642
|
3.8
|
5.4
|
1.0
|
OD2
|
F:ASP564
|
3.8
|
7.9
|
1.0
|
O1B
|
F:ADP1000
|
3.8
|
31.5
|
1.0
|
O3A
|
F:ADP1000
|
4.0
|
31.5
|
1.0
|
N
|
F:THR541
|
4.1
|
13.7
|
1.0
|
CA
|
F:THR541
|
4.3
|
13.7
|
1.0
|
O2B
|
F:ADP1000
|
4.3
|
31.5
|
1.0
|
CG2
|
F:THR541
|
4.4
|
13.7
|
1.0
|
OD1
|
F:ASP642
|
4.5
|
5.4
|
1.0
|
O2A
|
F:ADP1000
|
4.5
|
31.5
|
1.0
|
CG
|
F:ASP642
|
4.6
|
5.4
|
1.0
|
OH
|
E:TYR713
|
4.6
|
17.1
|
1.0
|
CB
|
F:MET540
|
4.7
|
10.8
|
1.0
|
PA
|
F:ADP1000
|
4.7
|
31.5
|
1.0
|
CE
|
F:MET540
|
4.7
|
10.8
|
1.0
|
O1A
|
F:ADP1000
|
4.8
|
31.5
|
1.0
|
CG
|
F:ASP564
|
4.9
|
7.9
|
1.0
|
O
|
F:THR643
|
4.9
|
4.3
|
1.0
|
|
Magnesium binding site 4 out
of 8 in 9exq
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Magnesium Binding Sites List in 9exq
Magnesium binding site 4 out
of 8 in the Wzc-K540M-3YE-N711Y Mgadp C1
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Wzc-K540M-3YE-N711Y Mgadp C1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Mg1001
b:31.5
occ:1.00
|
O3B
|
G:ADP1000
|
1.9
|
31.5
|
1.0
|
OG1
|
G:THR541
|
2.1
|
11.8
|
1.0
|
PB
|
G:ADP1000
|
3.3
|
31.5
|
1.0
|
CB
|
G:THR541
|
3.5
|
11.8
|
1.0
|
OD2
|
G:ASP642
|
3.6
|
2.8
|
1.0
|
OD2
|
G:ASP564
|
3.8
|
11.5
|
1.0
|
O1B
|
G:ADP1000
|
3.8
|
31.5
|
1.0
|
N
|
G:THR541
|
4.0
|
11.8
|
1.0
|
O2B
|
G:ADP1000
|
4.2
|
31.5
|
1.0
|
CA
|
G:THR541
|
4.3
|
11.8
|
1.0
|
O3A
|
G:ADP1000
|
4.3
|
31.5
|
1.0
|
CG2
|
G:THR541
|
4.4
|
11.8
|
1.0
|
CG
|
G:ASP642
|
4.4
|
2.8
|
1.0
|
OD1
|
G:ASP642
|
4.5
|
2.8
|
1.0
|
OH
|
F:TYR713
|
4.6
|
17.1
|
1.0
|
O2A
|
G:ADP1000
|
4.6
|
31.5
|
1.0
|
CG
|
G:ASP564
|
4.8
|
11.5
|
1.0
|
CB
|
G:MET540
|
4.8
|
11.3
|
1.0
|
O
|
G:THR643
|
4.9
|
1.0
|
1.0
|
O1A
|
G:ADP1000
|
4.9
|
31.5
|
1.0
|
PA
|
G:ADP1000
|
4.9
|
31.5
|
1.0
|
CE2
|
G:TYR569
|
5.0
|
35.9
|
1.0
|
C
|
G:MET540
|
5.0
|
11.3
|
1.0
|
|
Magnesium binding site 5 out
of 8 in 9exq
Go back to
Magnesium Binding Sites List in 9exq
Magnesium binding site 5 out
of 8 in the Wzc-K540M-3YE-N711Y Mgadp C1
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Wzc-K540M-3YE-N711Y Mgadp C1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Mg1001
b:23.5
occ:1.00
|
O3B
|
H:ADP1000
|
1.9
|
31.5
|
1.0
|
OG1
|
H:THR541
|
2.2
|
14.2
|
1.0
|
PB
|
H:ADP1000
|
3.3
|
31.5
|
1.0
|
CB
|
H:THR541
|
3.6
|
14.2
|
1.0
|
OD2
|
H:ASP642
|
3.7
|
56.1
|
1.0
|
OD2
|
H:ASP564
|
3.7
|
7.6
|
1.0
|
O1B
|
H:ADP1000
|
3.8
|
31.5
|
1.0
|
N
|
H:THR541
|
4.1
|
14.2
|
1.0
|
O2B
|
H:ADP1000
|
4.2
|
31.5
|
1.0
|
O3A
|
H:ADP1000
|
4.3
|
31.5
|
1.0
|
CA
|
H:THR541
|
4.4
|
14.2
|
1.0
|
OD1
|
H:ASP642
|
4.5
|
56.1
|
1.0
|
CG
|
H:ASP642
|
4.5
|
56.1
|
1.0
|
CG2
|
H:THR541
|
4.5
|
14.2
|
1.0
|
O2A
|
H:ADP1000
|
4.5
|
31.5
|
1.0
|
OH
|
G:TYR713
|
4.6
|
15.2
|
1.0
|
CB
|
H:MET540
|
4.7
|
10.5
|
1.0
|
O
|
H:THR643
|
4.8
|
31.5
|
1.0
|
CE
|
H:MET540
|
4.8
|
10.5
|
1.0
|
CG
|
H:ASP564
|
4.8
|
7.6
|
1.0
|
PA
|
H:ADP1000
|
4.9
|
31.5
|
1.0
|
O1A
|
H:ADP1000
|
4.9
|
31.5
|
1.0
|
|
Magnesium binding site 6 out
of 8 in 9exq
Go back to
Magnesium Binding Sites List in 9exq
Magnesium binding site 6 out
of 8 in the Wzc-K540M-3YE-N711Y Mgadp C1
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 6 of Wzc-K540M-3YE-N711Y Mgadp C1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg1001
b:23.7
occ:1.00
|
O3B
|
A:ADP1000
|
1.9
|
31.5
|
1.0
|
OG1
|
A:THR541
|
2.3
|
9.5
|
1.0
|
PB
|
A:ADP1000
|
3.1
|
31.5
|
1.0
|
O1B
|
A:ADP1000
|
3.4
|
31.5
|
1.0
|
CB
|
A:THR541
|
3.7
|
9.5
|
1.0
|
OD2
|
A:ASP564
|
3.7
|
8.2
|
1.0
|
OD2
|
A:ASP642
|
3.8
|
6.7
|
1.0
|
N
|
A:THR541
|
4.1
|
9.5
|
1.0
|
O3A
|
A:ADP1000
|
4.2
|
31.5
|
1.0
|
O2B
|
A:ADP1000
|
4.2
|
31.5
|
1.0
|
OD1
|
A:ASP642
|
4.4
|
6.7
|
1.0
|
CA
|
A:THR541
|
4.4
|
9.5
|
1.0
|
OH
|
H:TYR713
|
4.5
|
14.8
|
1.0
|
O2A
|
A:ADP1000
|
4.5
|
31.5
|
1.0
|
CG
|
A:ASP642
|
4.5
|
6.7
|
1.0
|
CG2
|
A:THR541
|
4.6
|
9.5
|
1.0
|
CB
|
A:MET540
|
4.7
|
8.4
|
1.0
|
PA
|
A:ADP1000
|
4.8
|
31.5
|
1.0
|
CE
|
A:MET540
|
4.8
|
8.4
|
1.0
|
CG
|
A:ASP564
|
4.8
|
8.2
|
1.0
|
O
|
A:THR643
|
4.8
|
4.8
|
1.0
|
O1A
|
A:ADP1000
|
4.9
|
31.5
|
1.0
|
CE2
|
A:TYR569
|
4.9
|
39.6
|
1.0
|
|
Magnesium binding site 7 out
of 8 in 9exq
Go back to
Magnesium Binding Sites List in 9exq
Magnesium binding site 7 out
of 8 in the Wzc-K540M-3YE-N711Y Mgadp C1
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 7 of Wzc-K540M-3YE-N711Y Mgadp C1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg1001
b:21.0
occ:1.00
|
O3B
|
B:ADP1000
|
1.9
|
31.5
|
1.0
|
OG1
|
B:THR541
|
2.3
|
11.9
|
1.0
|
PB
|
B:ADP1000
|
3.3
|
31.5
|
1.0
|
CB
|
B:THR541
|
3.6
|
11.9
|
1.0
|
OD2
|
B:ASP642
|
3.8
|
1.4
|
1.0
|
OD2
|
B:ASP564
|
3.8
|
7.7
|
1.0
|
O1B
|
B:ADP1000
|
3.8
|
31.5
|
1.0
|
N
|
B:THR541
|
4.1
|
11.9
|
1.0
|
O3A
|
B:ADP1000
|
4.2
|
31.5
|
1.0
|
O2B
|
B:ADP1000
|
4.2
|
31.5
|
1.0
|
CA
|
B:THR541
|
4.4
|
11.9
|
1.0
|
OH
|
A:TYR713
|
4.4
|
15.9
|
1.0
|
OD1
|
B:ASP642
|
4.4
|
1.4
|
1.0
|
CG
|
B:ASP642
|
4.5
|
1.4
|
1.0
|
CG2
|
B:THR541
|
4.6
|
11.9
|
1.0
|
O2A
|
B:ADP1000
|
4.6
|
31.5
|
1.0
|
CB
|
B:MET540
|
4.8
|
10.9
|
1.0
|
CE2
|
B:TYR569
|
4.8
|
34.1
|
1.0
|
O1A
|
B:ADP1000
|
4.8
|
31.5
|
1.0
|
CE
|
B:MET540
|
4.8
|
10.9
|
1.0
|
PA
|
B:ADP1000
|
4.8
|
31.5
|
1.0
|
CG
|
B:ASP564
|
4.8
|
7.7
|
1.0
|
O
|
B:THR643
|
4.9
|
1.7
|
1.0
|
|
Magnesium binding site 8 out
of 8 in 9exq
Go back to
Magnesium Binding Sites List in 9exq
Magnesium binding site 8 out
of 8 in the Wzc-K540M-3YE-N711Y Mgadp C1
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 8 of Wzc-K540M-3YE-N711Y Mgadp C1 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg1001
b:31.5
occ:1.00
|
O3B
|
C:ADP1000
|
1.9
|
14.1
|
1.0
|
OG1
|
C:THR541
|
2.2
|
5.9
|
1.0
|
PB
|
C:ADP1000
|
3.3
|
14.1
|
1.0
|
CB
|
C:THR541
|
3.6
|
5.9
|
1.0
|
OD2
|
C:ASP642
|
3.7
|
2.0
|
1.0
|
OD2
|
C:ASP564
|
3.7
|
7.3
|
1.0
|
O1B
|
C:ADP1000
|
3.8
|
14.1
|
1.0
|
N
|
C:THR541
|
4.1
|
5.9
|
1.0
|
O3A
|
C:ADP1000
|
4.2
|
14.1
|
1.0
|
O2B
|
C:ADP1000
|
4.2
|
14.1
|
1.0
|
CA
|
C:THR541
|
4.4
|
5.9
|
1.0
|
OD1
|
C:ASP642
|
4.4
|
2.0
|
1.0
|
CG
|
C:ASP642
|
4.4
|
2.0
|
1.0
|
OH
|
B:TYR713
|
4.5
|
16.2
|
1.0
|
CG2
|
C:THR541
|
4.5
|
5.9
|
1.0
|
O2A
|
C:ADP1000
|
4.8
|
14.1
|
1.0
|
CG
|
C:ASP564
|
4.8
|
7.3
|
1.0
|
O
|
C:THR643
|
4.8
|
1.3
|
1.0
|
CB
|
C:MET540
|
4.9
|
4.9
|
1.0
|
O1A
|
C:ADP1000
|
4.9
|
14.1
|
1.0
|
CE2
|
C:TYR569
|
4.9
|
34.5
|
1.0
|
PA
|
C:ADP1000
|
4.9
|
14.1
|
1.0
|
|
Reference:
Y.Yang,
J.W.Liu.
Bacterial Tyrosine Kinase Wzc To Be Published.
Page generated: Sat Aug 16 01:35:10 2025
|